[4-(5-nonoxypyrimidin-2-yl)phenyl] 2-propylpentanoate

Systemtic Name: [4-(5-nonoxypyrimidin-2-yl)phenyl] 2-propylpentanoate Openeye Name: [4-(5-nonoxypyrimidin-2-yl)phenyl] 2-propylpentanoate CAS Name: 2-propylpentanoic acid [4-(5-nonoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-nonoxypyrimidin-2-yl)phenyl] 2-propylpentanoate Traditional Name: 2-propylvaleric acid [4-(5-nonoxypyrimidin-2-yl)phenyl] ester Formula: C27H40N2O3 MolecularWeight: 440.6181

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(CCC)CCC

Isomeric SMILES

CCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(CCC)CCC

InChI

InChI=1S/C27H40N2O3/c1-4-7-8-9-10-11-12-19-31-25-20-28-26(29-21-25)22-15-17-24(18-16-22)32-27(30)23(13-5-2)14-6-3/h15-18,20-21,23H,4-14,19H2,1-3H3